2-Fluoro-4,6-bis(trifluoromethyl)benzyl bromide
Completing data — refresh the page later to see the latest
Basic information
- CAS
1017778-46-9- Standard SMILES
Fc1cc(C(F)(F)F)cc(C(F)(F)F)c1CBr- InChIKey
QORBTFMANPEXFJ-UHFFFAOYSA-N- Molecular formula
- C9H4BrF7
- Average molar mass
- 325.02 g/mol
- Monoisotopic mass
- 323.93846
Names & identifiers
- Preferred name
- 2-Fluoro-4,6-bis(trifluoromethyl)benzyl bromide
- IUPAC
- 2-(bromomethyl)-1-fluoro-3,5-bis(trifluoromethyl)benzene
- English name
- 2-FLUORO-4,6-BIS(TRIFLUOROMETHYL)BENZYL BROMIDE
- Molecular formula
- C9H4BrF7
- Molecular weight
- 325.02
Names & synonyms
1017778-46-92-FLUORO-4,6-BIS(TRIFLUOROMETHYL)BENZYL BROMIDE2-(bromomethyl)-1-fluoro-3,5-bis(trifluoromethyl)benzeneMFCD09258673DTXSID701201197AKOS015956748JS-4656Benzene, 2-(bromomethyl)-1-fluoro-3,5-bis(trifluoromethyl)-
Database identifiers
- CAS
1017778-46-9- PubChem CID
- 46737585
- DTXSID
DTXSID701201197
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- Boiling point
- 175.5 · 175.5±35.0 °C(Predicted)
- Density
- 1.709 · 1.709±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 280 · P280-P301+P330+P331-P303+P361+P353
- HS Code
- 2909309090 · 2909309090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2909309090
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Hazard statements
- H314
- Precautionary statements
- P280-P301+P330+P331-P303+P361+P353
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…